CID 34712

5,5-diisopropyltetrahydro-3-furanol

Structural Information

Molecular Formula
C10H20O2
SMILES
CC(C)C1(CC(CO1)O)C(C)C
InChI
InChI=1S/C10H20O2/c1-7(2)10(8(3)4)5-9(11)6-12-10/h7-9,11H,5-6H2,1-4H3
InChIKey
NCTFVWWTDZHSKZ-UHFFFAOYSA-N
Compound name
5,5-di(propan-2-yl)oxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.14633 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.15361 140.3
[M+Na]+ 195.13555 148.9
[M+NH4]+ 190.18015 149.6
[M+K]+ 211.10949 145.1
[M-H]- 171.13905 141.8
[M+Na-2H]- 193.12100 143.8
[M]+ 172.14578 141.9
[M]- 172.14688 141.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.